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Glutaric acid, 1-cyclopentylethyl cyclohexylmethyl ester
SpectraBase Compound ID iHWql6o01X
InChI InChI=1S/C19H32O4/c1-15(17-10-5-6-11-17)23-19(21)13-7-12-18(20)22-14-16-8-3-2-4-9-16/h15-17H,2-14H2,1H3
InChIKey SOGGQQDJRAWKGI-UHFFFAOYSA-N
Mol Weight 324.5 g/mol
Molecular Formula C19H32O4
Exact Mass 324.23006 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BDzqgzs2OvU
Name Glutaric acid, 1-cyclopentylethyl cyclohexylmethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 324.230059506 u
Formula C19H32O4
InChI InChI=1S/C19H32O4/c1-15(17-10-5-6-11-17)23-19(21)13-7-12-18(20)22-14-16-8-3-2-4-9-16/h15-17H,2-14H2,1H3
InChIKey SOGGQQDJRAWKGI-UHFFFAOYSA-N
Molecular Weight 324.461 g/mol
SMILES C(CCC(OCC1CCCCC1)=O)C(OC(C)C1CCCC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.929649